Basic information
- CAS
73855-86-4- Standard SMILES
CNC1CN(C2c3ccccc3CCc3ccc(Cl)cc32)C1- InChIKey
NKXUMYSBPSETEK-UHFFFAOYSA-N- Molecular formula
- C19H21ClN2
- Average molar mass
- 312.8 g/mol
- Monoisotopic mass
- 312.1393264
Names & identifiers
- Preferred name
- 1-(3-Chloro-10,11-dihydro-5H-dibenzo(a,d)cyclohepten-5-yl)-3-methylaminoazetidine
- IUPAC
- 1-(5-chloro-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)-N-methylazetidin-3-amine
- English name
- 1-[3-Chloro-10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-yl]-N-methyl-3-azetidinamine
- Molecular weight
- 0
Names & synonyms
73855-86-4BRN 04346671-(3-Chloro-10,11-dihydro-5H-dibenzo(a,d)cyclohepten-5-yl)-3-methylaminoazetidineAzetidine, 1-(3-chloro-10,11-dihydro-5H-dibenzo(a,d)cyclohepten-5-yl)-3-methylamino-CHEMBL3230907DTXSID609950041-(3-chloro-10,11-dihydro-5H-dibenzo[a,d][7]annulen-5-yl)-N-methylazetidin-3-amine1-[3-Chloro-10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-yl]-N-methyl-3-azetidinamine
Database identifiers
- CAS
73855-86-4- PubChem CID
- 52676
- DTXSID
DTXSID60995004- ChEMBL
CHEMBL3230907- Nikkaji
- J84.670H
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 15.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 382
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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